SCHEMBL4748563

SCHEMBL4748563

Cc1ccc(-c2nc(COc3ccc(C=O)cc3)co2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.49
PPARA Q07869 6/20 0.49
FFAR1 O14842 3/20 0.49
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
CYP2A6 P11509 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4747663 0.87 FFAR1 (0.63) PPARGPPARAFFAR1ALDH1A1SMN1; SMN2
SCHEMBL9261947 0.84 PPARG (0.49) PPARGPPARAFFAR1ALDH1A1SMN1; SMN2
SCHEMBL4788306 0.81 FFAR1 (0.53) PPARGPPARAFFAR1SMN1; SMN2NPC1
SCHEMBL4747385 0.81 FFAR1 (0.56) PPARGPPARAFFAR1NPC1RAB9A
SCHEMBL4747685 0.75 FFAR1 (0.52) PPARGPPARAFFAR1ALDH1A1SMN1; SMN2
SCHEMBL9520727 0.75 PPARG (0.43) PPARGPPARA
SCHEMBL4748219 0.74 MAOA (0.56) PPARGPPARAFFAR1NPC1RAB9A
SCHEMBL9178901 0.74 MAOA (0.58) PPARGPPARAFFAR1LMNANPC1
SCHEMBL14128011 0.74 MAOB (0.61) FFAR1ALDH1A1SMN1; SMN2KDM4ELMNA
SCHEMBL260403 0.74 MAOB (0.61) FFAR1ALDH1A1SMN1; SMN2KDM4ELMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008117982-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR INHIBITING LIPID ACCUMULATION CONTAINING SAME CRYSTAL GENOMICS, INC. (KR) 2008-10-02 WO disclosed